N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide

C12H17N3 — CID 63489252

IUPACN',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide
SMILESC/N=C(\N)N1CC(C)Cc2ccccc21
InChIInChI=1S/C12H17N3/c1-9-7-10-5-3-4-6-11(10)15(8-9)12(13)14-2/h3-6,9H,7-8H2,1-2H3,(H2,13,14)
InChIKeyATWKKJKJRIISOU-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.63
Rot. Bonds

About N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide

N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide (PubChem CID 63489252) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide.

Molecular Properties

Compound NameN',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide
PubChem CID63489252
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC NameN',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide
SMILESC/N=C(\N)N1CC(C)Cc2ccccc21
InChIInChI=1S/C12H17N3/c1-9-7-10-5-3-4-6-11(10)15(8-9)12(13)14-2/h3-6,9H,7-8H2,1-2H3,(H2,13,14)
InChIKeyATWKKJKJRIISOU-UHFFFAOYSA-N
XLogP1.63
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

3-amino-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 63466515
(2R)-2-amino-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one;hydrochloride
CID 119319569
(2-aminophenyl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 63401608
2-amino-3-methyl-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
CID 63522833
N'-hydroxy-1-(3-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)cyclobutane-1-carboximidamide
CID 80598659
1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)but-2-yn-1-one
CID 166787570
1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(nitrosomethyl)prop-2-en-1-one
CID 166787687
(1-aminocyclobutyl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 81169109
(2R)-2-amino-3,3-dimethyl-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
CID 103929918
2-amino-2-cyclopropyl-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 55196224
3-methyl-N-phenyl-3,4-dihydro-2H-quinoline-1-carbothioamide
CID 115612180
(3S)-1,3-dimethyl-3,4-dihydro-2H-quinoline
CID 40526138

Frequently Asked Questions

What is the IUPAC name of N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide?
The IUPAC name of N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide (CID 63489252) is N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide.
What is the SMILES notation for N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide?
The canonical SMILES for N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide is C/N=C(\N)N1CC(C)Cc2ccccc21.
What is the InChIKey of N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide?
The InChIKey is ATWKKJKJRIISOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-9-7-10-5-3-4-6-11(10)15(8-9)12(13)14-2/h3-6,9H,7-8H2,1-2H3,(H2,13,14).
What are the key properties of N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide?
N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide has a molecular weight of 203.29 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N',3-dimethyl-3,4-dihydro-2H-quinoline-1-carboximidamide is sourced from PubChem (CID 63489252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).